1-(10,20-diphenyl-23,24-dihydroporphyrin-5-yl)but-3-en-1-ol

Systemtic Name: 1-(10,20-diphenyl-23,24-dihydroporphyrin-5-yl)but-3-en-1-ol Openeye Name: 1-(10,20-diphenyl-23,24-dihydroporphyrin-5-yl)but-3-en-1-ol CAS Name: 1-(10,20-diphenyl-23,24-dihydroporphyrin-5-yl)-3-buten-1-ol IUPAC Name: 1-(10,20-diphenyl-23,24-dihydroporphyrin-5-yl)but-3-en-1-ol Traditional Name: 1-(10,20-diphenyl-23,24-dihydroporphin-5-yl)but-3-en-1-ol Formula: C36H28N4O MolecularWeight: 532.63372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCC(C1=C2C=CC(=N2)C(=C3C=CC(=CC4=CC=C(N4)C(=C5C=CC1=N5)C6=CC=CC=C6)N3)C7=CC=CC=C7)O

Isomeric SMILES

C=CCC(C1=C2C=CC(=N2)C(=C3C=CC(=CC4=CC=C(N4)C(=C5C=CC1=N5)C6=CC=CC=C6)N3)C7=CC=CC=C7)O

InChI

InChI=1S/C36H28N4O/c1-2-9-33(41)36-31-20-18-29(39-31)34(23-10-5-3-6-11-23)27-16-14-25(37-27)22-26-15-17-28(38-26)35(24-12-7-4-8-13-24)30-19-21-32(36)40-30/h2-8,10-22,33,37-38,41H,1,9H2